! Pwscf input file created with ciftopw.py 
! Compound: Cu2As
&control
         calculation     = 'bands'
         prefix          = 'Cu2As'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =            7.1582820463319994
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.5686378035902853
         celldm(4)       =            0.0000000000000001
         celldm(5)       =            0.0000000000000001
         celldm(6)       =            0.0000000000000001
         nat             =        6
         ntyp            =        2
         ecutwfc         =       46.00000000
         ecutrho         =      237.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-05 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
As  74.9216 As.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Cu  63.5460 Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
376
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.01190476       0.00000000 1.0 
      0.00000000       0.02380952       0.00000000 1.0 
      0.00000000       0.03571429       0.00000000 1.0 
      0.00000000       0.04761905       0.00000000 1.0 
      0.00000000       0.05952381       0.00000000 1.0 
      0.00000000       0.07142857       0.00000000 1.0 
      0.00000000       0.08333333       0.00000000 1.0 
      0.00000000       0.09523810       0.00000000 1.0 
      0.00000000       0.10714286       0.00000000 1.0 
      0.00000000       0.11904762       0.00000000 1.0 
      0.00000000       0.13095238       0.00000000 1.0 
      0.00000000       0.14285714       0.00000000 1.0 
      0.00000000       0.15476190       0.00000000 1.0 
      0.00000000       0.16666667       0.00000000 1.0 
      0.00000000       0.17857143       0.00000000 1.0 
      0.00000000       0.19047619       0.00000000 1.0 
      0.00000000       0.20238095       0.00000000 1.0 
      0.00000000       0.21428571       0.00000000 1.0 
      0.00000000       0.22619048       0.00000000 1.0 
      0.00000000       0.23809524       0.00000000 1.0 
      0.00000000       0.25000000       0.00000000 1.0 
      0.00000000       0.26190476       0.00000000 1.0 
      0.00000000       0.27380952       0.00000000 1.0 
      0.00000000       0.28571429       0.00000000 1.0 
      0.00000000       0.29761905       0.00000000 1.0 
      0.00000000       0.30952381       0.00000000 1.0 
      0.00000000       0.32142857       0.00000000 1.0 
      0.00000000       0.33333333       0.00000000 1.0 
      0.00000000       0.34523810       0.00000000 1.0 
      0.00000000       0.35714286       0.00000000 1.0 
      0.00000000       0.36904762       0.00000000 1.0 
      0.00000000       0.38095238       0.00000000 1.0 
      0.00000000       0.39285714       0.00000000 1.0 
      0.00000000       0.40476190       0.00000000 1.0 
      0.00000000       0.41666667       0.00000000 1.0 
      0.00000000       0.42857143       0.00000000 1.0 
      0.00000000       0.44047619       0.00000000 1.0 
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      0.00000000       0.48809524       0.00000000 1.0 
      0.00000000       0.50000000       0.00000000 1.0 
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      0.01190476       0.50000000       0.00000000 1.0 
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      0.03571429       0.50000000       0.00000000 1.0 
      0.04761905       0.50000000       0.00000000 1.0 
      0.05952381       0.50000000       0.00000000 1.0 
      0.07142857       0.50000000       0.00000000 1.0 
      0.08333333       0.50000000       0.00000000 1.0 
      0.09523810       0.50000000       0.00000000 1.0 
      0.10714286       0.50000000       0.00000000 1.0 
      0.11904762       0.50000000       0.00000000 1.0 
      0.13095238       0.50000000       0.00000000 1.0 
      0.14285714       0.50000000       0.00000000 1.0 
      0.15476190       0.50000000       0.00000000 1.0 
      0.16666667       0.50000000       0.00000000 1.0 
      0.17857143       0.50000000       0.00000000 1.0 
      0.19047619       0.50000000       0.00000000 1.0 
      0.20238095       0.50000000       0.00000000 1.0 
      0.21428571       0.50000000       0.00000000 1.0 
      0.22619048       0.50000000       0.00000000 1.0 
      0.23809524       0.50000000       0.00000000 1.0 
      0.25000000       0.50000000       0.00000000 1.0 
      0.26190476       0.50000000       0.00000000 1.0 
      0.27380952       0.50000000       0.00000000 1.0 
      0.28571429       0.50000000       0.00000000 1.0 
      0.29761905       0.50000000       0.00000000 1.0 
      0.30952381       0.50000000       0.00000000 1.0 
      0.32142857       0.50000000       0.00000000 1.0 
      0.33333333       0.50000000       0.00000000 1.0 
      0.34523810       0.50000000       0.00000000 1.0 
      0.35714286       0.50000000       0.00000000 1.0 
      0.36904762       0.50000000       0.00000000 1.0 
      0.38095238       0.50000000       0.00000000 1.0 
      0.39285714       0.50000000       0.00000000 1.0 
      0.40476190       0.50000000       0.00000000 1.0 
      0.41666667       0.50000000       0.00000000 1.0 
      0.42857143       0.50000000       0.00000000 1.0 
      0.44047619       0.50000000       0.00000000 1.0 
      0.45238095       0.50000000       0.00000000 1.0 
      0.46428571       0.50000000       0.00000000 1.0 
      0.47619048       0.50000000       0.00000000 1.0 
      0.48809524       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.49152542       0.49152542       0.00000000 1.0 
      0.48305085       0.48305085       0.00000000 1.0 
      0.47457627       0.47457627       0.00000000 1.0 
      0.46610169       0.46610169       0.00000000 1.0 
      0.45762712       0.45762712       0.00000000 1.0 
      0.44915254       0.44915254       0.00000000 1.0 
      0.44067797       0.44067797       0.00000000 1.0 
      0.43220339       0.43220339       0.00000000 1.0 
      0.42372881       0.42372881       0.00000000 1.0 
      0.41525424       0.41525424       0.00000000 1.0 
      0.40677966       0.40677966       0.00000000 1.0 
      0.39830508       0.39830508       0.00000000 1.0 
      0.38983051       0.38983051       0.00000000 1.0 
      0.38135593       0.38135593       0.00000000 1.0 
      0.37288136       0.37288136       0.00000000 1.0 
      0.36440678       0.36440678       0.00000000 1.0 
      0.35593220       0.35593220       0.00000000 1.0 
      0.34745763       0.34745763       0.00000000 1.0 
      0.33898305       0.33898305       0.00000000 1.0 
      0.33050847       0.33050847       0.00000000 1.0 
      0.32203390       0.32203390       0.00000000 1.0 
      0.31355932       0.31355932       0.00000000 1.0 
      0.30508475       0.30508475       0.00000000 1.0 
      0.29661017       0.29661017       0.00000000 1.0 
      0.28813559       0.28813559       0.00000000 1.0 
      0.27966102       0.27966102       0.00000000 1.0 
      0.27118644       0.27118644       0.00000000 1.0 
      0.26271186       0.26271186       0.00000000 1.0 
      0.25423729       0.25423729       0.00000000 1.0 
      0.24576271       0.24576271       0.00000000 1.0 
      0.23728814       0.23728814       0.00000000 1.0 
      0.22881356       0.22881356       0.00000000 1.0 
      0.22033898       0.22033898       0.00000000 1.0 
      0.21186441       0.21186441       0.00000000 1.0 
      0.20338983       0.20338983       0.00000000 1.0 
      0.19491525       0.19491525       0.00000000 1.0 
      0.18644068       0.18644068       0.00000000 1.0 
      0.17796610       0.17796610       0.00000000 1.0 
      0.16949153       0.16949153       0.00000000 1.0 
      0.16101695       0.16101695       0.00000000 1.0 
      0.15254237       0.15254237       0.00000000 1.0 
      0.14406780       0.14406780       0.00000000 1.0 
      0.13559322       0.13559322       0.00000000 1.0 
      0.12711864       0.12711864       0.00000000 1.0 
      0.11864407       0.11864407       0.00000000 1.0 
      0.11016949       0.11016949       0.00000000 1.0 
      0.10169492       0.10169492       0.00000000 1.0 
      0.09322034       0.09322034       0.00000000 1.0 
      0.08474576       0.08474576       0.00000000 1.0 
      0.07627119       0.07627119       0.00000000 1.0 
      0.06779661       0.06779661       0.00000000 1.0 
      0.05932203       0.05932203       0.00000000 1.0 
      0.05084746       0.05084746       0.00000000 1.0 
      0.04237288       0.04237288       0.00000000 1.0 
      0.03389831       0.03389831       0.00000000 1.0 
      0.02542373       0.02542373       0.00000000 1.0 
      0.01694915       0.01694915       0.00000000 1.0 
      0.00847458       0.00847458       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
     -0.00000000      -0.00000000       0.01851852 1.0 
     -0.00000000      -0.00000000       0.03703704 1.0 
      0.00000000       0.00000000       0.05555556 1.0 
     -0.00000000      -0.00000000       0.07407407 1.0 
      0.00000000      -0.00000000       0.09259259 1.0 
      0.00000000       0.00000000       0.11111111 1.0 
     -0.00000000       0.00000000       0.12962963 1.0 
     -0.00000000      -0.00000000       0.14814815 1.0 
      0.00000000       0.00000000       0.16666667 1.0 
      0.00000000      -0.00000000       0.18518519 1.0 
      0.00000000      -0.00000000       0.20370370 1.0 
      0.00000000       0.00000000       0.22222222 1.0 
     -0.00000000      -0.00000000       0.24074074 1.0 
     -0.00000000       0.00000000       0.25925926 1.0 
     -0.00000000      -0.00000000       0.27777778 1.0 
     -0.00000000      -0.00000000       0.29629630 1.0 
      0.00000000       0.00000000       0.31481481 1.0 
      0.00000000       0.00000000       0.33333333 1.0 
      0.00000000       0.00000000       0.35185185 1.0 
      0.00000000      -0.00000000       0.37037037 1.0 
      0.00000000      -0.00000000       0.38888889 1.0 
      0.00000000      -0.00000000       0.40740741 1.0 
     -0.00000000      -0.00000000       0.42592593 1.0 
      0.00000000       0.00000000       0.44444444 1.0 
      0.00000000       0.00000000       0.46296296 1.0 
     -0.00000000      -0.00000000       0.48148148 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.00000000       0.50000000 1.0 
      0.00000000       0.01190476       0.50000000 1.0 
      0.00000000       0.02380952       0.50000000 1.0 
      0.00000000       0.03571429       0.50000000 1.0 
      0.00000000       0.04761905       0.50000000 1.0 
      0.00000000       0.05952381       0.50000000 1.0 
      0.00000000       0.07142857       0.50000000 1.0 
      0.00000000       0.08333333       0.50000000 1.0 
      0.00000000       0.09523810       0.50000000 1.0 
      0.00000000       0.10714286       0.50000000 1.0 
      0.00000000       0.11904762       0.50000000 1.0 
      0.00000000       0.13095238       0.50000000 1.0 
      0.00000000       0.14285714       0.50000000 1.0 
      0.00000000       0.15476190       0.50000000 1.0 
      0.00000000       0.16666667       0.50000000 1.0 
      0.00000000       0.17857143       0.50000000 1.0 
      0.00000000       0.19047619       0.50000000 1.0 
      0.00000000       0.20238095       0.50000000 1.0 
      0.00000000       0.21428571       0.50000000 1.0 
      0.00000000       0.22619048       0.50000000 1.0 
      0.00000000       0.23809524       0.50000000 1.0 
      0.00000000       0.25000000       0.50000000 1.0 
      0.00000000       0.26190476       0.50000000 1.0 
      0.00000000       0.27380952       0.50000000 1.0 
      0.00000000       0.28571429       0.50000000 1.0 
      0.00000000       0.29761905       0.50000000 1.0 
      0.00000000       0.30952381       0.50000000 1.0 
      0.00000000       0.32142857       0.50000000 1.0 
      0.00000000       0.33333333       0.50000000 1.0 
      0.00000000       0.34523810       0.50000000 1.0 
      0.00000000       0.35714286       0.50000000 1.0 
      0.00000000       0.36904762       0.50000000 1.0 
      0.00000000       0.38095238       0.50000000 1.0 
      0.00000000       0.39285714       0.50000000 1.0 
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      0.00000000       0.41666667       0.50000000 1.0 
      0.00000000       0.42857143       0.50000000 1.0 
      0.00000000       0.44047619       0.50000000 1.0 
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      0.15476190       0.50000000       0.50000000 1.0 
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      0.30952381       0.50000000       0.50000000 1.0 
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      0.34523810       0.50000000       0.50000000 1.0 
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      0.50000000       0.50000000       0.35185185 1.0 
      0.50000000       0.50000000       0.37037037 1.0 
      0.50000000       0.50000000       0.38888889 1.0 
      0.50000000       0.50000000       0.40740741 1.0 
      0.50000000       0.50000000       0.42592593 1.0 
      0.50000000       0.50000000       0.44444444 1.0 
      0.50000000       0.50000000       0.46296296 1.0 
      0.50000000       0.50000000       0.48148148 1.0 
      0.50000000       0.50000000       0.50000000 1.0 

